diff options
Diffstat (limited to 'docs')
| -rw-r--r-- | docs/authors.html | 2 | ||||
| -rw-r--r-- | docs/index.html | 2 | ||||
| -rw-r--r-- | docs/reference/chent.html | 4 | ||||
| -rw-r--r-- | docs/reference/draw_svg.chent.html | 2 | ||||
| -rw-r--r-- | docs/reference/index.html | 2 | ||||
| -rw-r--r-- | docs/reference/pai.html | 2 | ||||
| -rw-r--r-- | docs/reference/plot.chent.html | 2 | ||||
| -rw-r--r-- | docs/reference/pp.html | 2 | ||||
| -rw-r--r-- | docs/reference/print.chent.html | 2 | ||||
| -rw-r--r-- | docs/reference/print.pai.html | 2 |
10 files changed, 11 insertions, 11 deletions
diff --git a/docs/authors.html b/docs/authors.html index 5ac526d..3274797 100644 --- a/docs/authors.html +++ b/docs/authors.html @@ -60,7 +60,7 @@ </button> <span class="navbar-brand"> <a class="navbar-link" href="index.html">chents</a> - <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.6</span> + <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.7</span> </span> </div> diff --git a/docs/index.html b/docs/index.html index f463fe0..6d69e3f 100644 --- a/docs/index.html +++ b/docs/index.html @@ -35,7 +35,7 @@ </button> <span class="navbar-brand"> <a class="navbar-link" href="index.html">chents</a> - <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.6</span> + <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.7</span> </span> </div> diff --git a/docs/reference/chent.html b/docs/reference/chent.html index 369b0a0..3d0928c 100644 --- a/docs/reference/chent.html +++ b/docs/reference/chent.html @@ -65,7 +65,7 @@ python bindings are installed and configured for use with PythonInR." /> </button> <span class="navbar-brand"> <a class="navbar-link" href="../index.html">chents</a> - <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.6</span> + <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.7</span> </span> </div> @@ -149,7 +149,7 @@ configured for use with PythonInR</p></dd> <pre class="examples"><div class='input'><span class='no'>oct</span> <span class='kw'><-</span> <span class='no'>chent</span>$<span class='fu'>new</span>(<span class='st'>"1-octanol"</span>, <span class='kw'>smiles</span> <span class='kw'>=</span> <span class='st'>"CCCCCCCCO"</span>)</div><div class='output co'>#> <span class='message'>PubChem:</span></div><div class='output co'>#> <span class='message'>https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/name/cids/JSON</span></div><div class='output co'>#> <span class='message'>https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/cid/property/MolecularFormula,MolecularWeight,CanonicalSMILES,IsomericSMILES,InChI,InChIKey,IUPACName,XLogP,TPSA,Complexity,Charge,HBondDonorCount,HBondAcceptorCount/JSON</span></div><div class='output co'>#> <span class='message'>https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/cid/synonyms/JSON</span></div><div class='output co'>#> <span class='message'></span> #> <span class='message'>Initialize Python Version 2.7.13 (default, Sep 26 2018, 18:42:22) </span> #> <span class='message'>[GCC 6.3.0 20170516]</span></div><div class='output co'>#> <span class='message'>Trying to get chemical information from RDKit using User SMILES</span> -#> <span class='message'>CCCCCCCCO</span></div><div class='output co'>#> <span class='message'>Lade nötigen Namensraum: grConvert</span></div><div class='output co'>#> <span class='message'>Did not find chyaml file ./1-octanol.yaml</span></div><div class='input'><span class='fu'><a href='https://www.rdocumentation.org/packages/base/topics/print'>print</a></span>(<span class='no'>oct</span>)</div><div class='output co'>#> <chent> +#> <span class='message'>CCCCCCCCO</span></div><div class='output co'>#> <span class='message'>Did not find chyaml file ./1-octanol.yaml</span></div><div class='input'><span class='fu'><a href='https://www.rdocumentation.org/packages/base/topics/print'>print</a></span>(<span class='no'>oct</span>)</div><div class='output co'>#> <chent> #> Identifier $identifier 1-octanol #> InChI Key $inchikey KBPLFHHGFOOTCA-UHFFFAOYSA-N #> SMILES string $smiles: diff --git a/docs/reference/draw_svg.chent.html b/docs/reference/draw_svg.chent.html index 54fec7c..582aa0c 100644 --- a/docs/reference/draw_svg.chent.html +++ b/docs/reference/draw_svg.chent.html @@ -63,7 +63,7 @@ </button> <span class="navbar-brand"> <a class="navbar-link" href="../index.html">chents</a> - <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.6</span> + <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.7</span> </span> </div> diff --git a/docs/reference/index.html b/docs/reference/index.html index e05a1c4..f08563c 100644 --- a/docs/reference/index.html +++ b/docs/reference/index.html @@ -60,7 +60,7 @@ </button> <span class="navbar-brand"> <a class="navbar-link" href="../index.html">chents</a> - <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.6</span> + <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.7</span> </span> </div> diff --git a/docs/reference/pai.html b/docs/reference/pai.html index d90bcc9..e240e11 100644 --- a/docs/reference/pai.html +++ b/docs/reference/pai.html @@ -64,7 +64,7 @@ Additional chemical information is retrieved from the internet if available." /> </button> <span class="navbar-brand"> <a class="navbar-link" href="../index.html">chents</a> - <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.6</span> + <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.7</span> </span> </div> diff --git a/docs/reference/plot.chent.html b/docs/reference/plot.chent.html index 026c25f..fddd2e8 100644 --- a/docs/reference/plot.chent.html +++ b/docs/reference/plot.chent.html @@ -63,7 +63,7 @@ </button> <span class="navbar-brand"> <a class="navbar-link" href="../index.html">chents</a> - <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.6</span> + <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.7</span> </span> </div> diff --git a/docs/reference/pp.html b/docs/reference/pp.html index 8dbed29..aa660cb 100644 --- a/docs/reference/pp.html +++ b/docs/reference/pp.html @@ -63,7 +63,7 @@ </button> <span class="navbar-brand"> <a class="navbar-link" href="../index.html">chents</a> - <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.6</span> + <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.7</span> </span> </div> diff --git a/docs/reference/print.chent.html b/docs/reference/print.chent.html index 8ab91bc..8f0dd0d 100644 --- a/docs/reference/print.chent.html +++ b/docs/reference/print.chent.html @@ -63,7 +63,7 @@ </button> <span class="navbar-brand"> <a class="navbar-link" href="../index.html">chents</a> - <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.6</span> + <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.7</span> </span> </div> diff --git a/docs/reference/print.pai.html b/docs/reference/print.pai.html index 7f8c6f3..add2687 100644 --- a/docs/reference/print.pai.html +++ b/docs/reference/print.pai.html @@ -63,7 +63,7 @@ </button> <span class="navbar-brand"> <a class="navbar-link" href="../index.html">chents</a> - <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.6</span> + <span class="version label label-default" data-toggle="tooltip" data-placement="bottom" title="Released version">0.2.7</span> </span> </div> |